Vitas-M small molecule compound

5-(dec-9-en-1-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK562044
SMILES C=CCCCCCCCCc1nnc([nH]1)S

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H21N3S MW 239.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H21N3S/c1-2-3-4-5-6-7-8-9-10-11-13-12(16)15-14-11/h2H,1,3-10H2,(H2,13,14,15,16)
InChIKey
LYHBBFWSTRLHKB-UHFFFAOYSA-N
Synonyms
4636-80-0
3(dec9en1yl)1H124triazole5thiol
4636800
5(DEC9EN1YL)12DIHYDRO3H124TRIAZOLE3THIONE
5(dec9en1yl)4H124triazole3thiol
5DEC9ENYL12DIHYDRO124TRIAZOLE3THIONE
5DEC9ENYL2H(124)TRIAZOLE3THIOL
C=CCCCCCCCCC1=NC(=S)NN1
C=CCCCCCCCCc1n(nH)c(n1)S
C=CCCCCCCCCc1nnc((nH)1)S
InChI=1SC12H21N3Sc12345678910111312(16)151411h2H1310H2(H213141516)
MFCD03804295
ZINC000005828747
ZINC5828747

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.